Home Carboxys 2-Azetidinecarboxylic acid, 1,3-dimethyl, (2s)-

2-Azetidinecarboxylic acid, 1,3-dimethyl, (2s)-

CAS No.:
1860067-54-4
Catalog Number:
AG00IKQ9
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
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Product Description
Catalog Number:
AG00IKQ9
Chemical Name:
2-Azetidinecarboxylic acid, 1,3-dimethyl, (2s)-
CAS Number:
1860067-54-4
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
MDL Number:
MFCD30146476
IUPAC Name:
(2S)-1,3-dimethylazetidine-2-carboxylic acid
InChI:
InChI=1S/C6H11NO2/c1-4-3-7(2)5(4)6(8)9/h4-5H,3H2,1-2H3,(H,8,9)/t4?,5-/m0/s1
InChI Key:
BCJSJTVMZBUSRL-AKGZTFGVSA-N
SMILES:
CC1CN([C@@H]1C(=O)O)C
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
129.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
129.159g/mol
Monoisotopic Mass:
129.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8  
Properties